Benzene expansion Janus GC base analogues: A detailed theoretical study

Hongxia Liu,Gang Qi,Qixia Song,Haijun Wang

Journal of Photochemistry and Photobiology A: Chemistry（2018）

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摘要

•The structural and optical properties are studied using DFT and TDDFT methods.•The Janus GC bases retain the mode and strength of H-bonds.•Water and base pairing can affect on the properties of excited states.

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关键词

Janus GC bases,Benzene expansion,DFT,TD-DFT

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